2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide

C10H16N4O2 — CID 92632010

IUPAC2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
SMILESNc1cnn(CC(=O)NC[C@@H]2CCCO2)c1
InChIInChI=1S/C10H16N4O2/c11-8-4-13-14(6-8)7-10(15)12-5-9-2-1-3-16-9/h4,6,9H,1-3,5,7,11H2,(H,12,15)/t9-/m0/s1
InChIKeyVHIAVNMVRAYPKS-VIFPVBQESA-N
MW224.26 g/mol
LogP-0.24
Rot. Bonds4

About 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide

2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide (PubChem CID 92632010) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
PubChem CID92632010
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
SMILESNc1cnn(CC(=O)NC[C@@H]2CCCO2)c1
InChIInChI=1S/C10H16N4O2/c11-8-4-13-14(6-8)7-10(15)12-5-9-2-1-3-16-9/h4,6,9H,1-3,5,7,11H2,(H,12,15)/t9-/m0/s1
InChIKeyVHIAVNMVRAYPKS-VIFPVBQESA-N
XLogP-0.24
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-[(2-methyloxolan-3-yl)methyl]acetamide
CID 114104631
2-[4-(hydroxymethyl)triazol-1-yl]-N-(oxolan-2-ylmethyl)acetamide
CID 62401850
2-(4-aminopyrazol-1-yl)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 43533738
N-cyclopropyl-2-[4-(oxolan-2-ylmethylamino)pyrazol-1-yl]acetamide
CID 82836260
2-(4-aminopyrazol-1-yl)-N-(2-methyloxolan-3-yl)acetamide
CID 82725311
N-(oxolan-2-ylmethyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 19530729
methyl N-[1-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]triazol-4-yl]carbamate
CID 112520366
2-(4-aminopyrazol-1-yl)-N-(oxan-4-yl)acetamide
CID 43609571
3-ethyl-5-methyl-N-[1-[2-oxo-2-[[(2R)-oxolan-2-yl]methylamino]ethyl]pyrazol-4-yl]-1,2-oxazole-4-carboxamide
CID 92632233
6-methoxy-N-[1-[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl]pyrazol-4-yl]pyridine-3-carboxamide
CID 92632097
2-(2-methoxyphenyl)-N-[1-[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl]pyrazol-4-yl]acetamide
CID 125164163
2-[4-[(4-fluorophenoxy)methyl]triazol-1-yl]-N-(oxolan-2-ylmethyl)acetamide
CID 110210647

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide (CID 92632010) is 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide is Nc1cnn(CC(=O)NC[C@@H]2CCCO2)c1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide?
The InChIKey is VHIAVNMVRAYPKS-VIFPVBQESA-N. The full InChI is InChI=1S/C10H16N4O2/c11-8-4-13-14(6-8)7-10(15)12-5-9-2-1-3-16-9/h4,6,9H,1-3,5,7,11H2,(H,12,15)/t9-/m0/s1.
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide?
2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide has a molecular weight of 224.26 g/mol, XLogP of -0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide is sourced from PubChem (CID 92632010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).